3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one

C11H20N2O — CID 79359236

IUPAC3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one
SMILESCC1(C)C(N2CCC(N)C2=O)C1(C)C
InChIInChI=1S/C11H20N2O/c1-10(2)9(11(10,3)4)13-6-5-7(12)8(13)14/h7,9H,5-6,12H2,1-4H3
InChIKeyRDADYZLTLCNRBP-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.98
Rot. Bonds1

About 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one

3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one (PubChem CID 79359236) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one.

Molecular Properties

Compound Name3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one
PubChem CID79359236
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one
SMILESCC1(C)C(N2CCC(N)C2=O)C1(C)C
InChIInChI=1S/C11H20N2O/c1-10(2)9(11(10,3)4)13-6-5-7(12)8(13)14/h7,9H,5-6,12H2,1-4H3
InChIKeyRDADYZLTLCNRBP-UHFFFAOYSA-N
XLogP0.98
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
The IUPAC name of 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one (CID 79359236) is 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one.
What is the SMILES notation for 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
The canonical SMILES for 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one is CC1(C)C(N2CCC(N)C2=O)C1(C)C.
What is the InChIKey of 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
The InChIKey is RDADYZLTLCNRBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-10(2)9(11(10,3)4)13-6-5-7(12)8(13)14/h7,9H,5-6,12H2,1-4H3.
What are the key properties of 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one?
3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one has a molecular weight of 196.29 g/mol, XLogP of 0.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one is sourced from PubChem (CID 79359236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).